1-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-amine chloride

Systemtic Name: 1-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-amine chloride Openeye Name: 1-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-amine chloride CAS Name: 1-(1-benzotriazolylmethyl)-2-pyridin-1-iumamine chloride IUPAC Name: 1-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-amine chloride Traditional Name: [1-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-yl]amine chloride Formula: C12H12ClN5 MolecularWeight: 261.71018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C[N+]3=CC=CC=C3N.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C[N+]3=CC=CC=C3N.[Cl-]

InChI

InChI=1S/C12H11N5.ClH/c13-12-7-3-4-8-16(12)9-17-11-6-2-1-5-10(11)14-15-17;/h1-8,13H,9H2;1H